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Data for: Strand structure controls photoinduced self-repair of RNA uracil dimers

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DataCite Commons2025-12-19 更新2026-04-25 收录
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https://figshare.com/articles/dataset/Data_for_Strand_structure_controls_photoinduced_self-repair_of_RNA_uracil_dimers/30922880
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资源简介:
Result of quantum chemical and QM/MM calculations for damaged GAU=U and U=UAG tetranucleotides and clustering analyses of molecular dynamics trajectories simulated to study their conformational spaces. Includes: input and output files of Turbomole and Orca quantum chemistry programs, analyses of electronic excitations performed with the TheoDore 3.2 package, PDB and XYZ files of molecular geometries.
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figshare
创建时间:
2025-12-19
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